N-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide

C9H8N2OS2 — CID 1473850

IUPACN-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
SMILESCNC(=O)c1csc(-c2cccs2)n1
InChIInChI=1S/C9H8N2OS2/c1-10-8(12)6-5-14-9(11-6)7-3-2-4-13-7/h2-5H,1H3,(H,10,12)
InChIKeyVFANSSLFXLATKG-UHFFFAOYSA-N
MW224.31 g/mol
LogP2.23
Rot. Bonds2

About N-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide

N-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide (PubChem CID 1473850) has the molecular formula C9H8N2OS2 and a molecular weight of 224.31 g/mol. Its IUPAC name is N-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
PubChem CID1473850
Molecular FormulaC9H8N2OS2
Molecular Weight224.31 g/mol
Exact Mass224.01
IUPAC NameN-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
SMILESCNC(=O)c1csc(-c2cccs2)n1
InChIInChI=1S/C9H8N2OS2/c1-10-8(12)6-5-14-9(11-6)7-3-2-4-13-7/h2-5H,1H3,(H,10,12)
InChIKeyVFANSSLFXLATKG-UHFFFAOYSA-N
XLogP2.23
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide (CID 1473850) is N-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide is CNC(=O)c1csc(-c2cccs2)n1.
What is the InChIKey of N-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide?
The InChIKey is VFANSSLFXLATKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS2/c1-10-8(12)6-5-14-9(11-6)7-3-2-4-13-7/h2-5H,1H3,(H,10,12).
What are the key properties of N-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide?
N-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide has a molecular weight of 224.31 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 1473850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).